4-(cyclopenten-1-yl)-1,2-dimethoxybenzene

C13H16O2 — CID 71373642

IUPAC4-(cyclopenten-1-yl)-1,2-dimethoxybenzene
SMILESCOc1ccc(C2=CCCC2)cc1OC
InChIInChI=1S/C13H16O2/c1-14-12-8-7-11(9-13(12)15-2)10-5-3-4-6-10/h5,7-9H,3-4,6H2,1-2H3
InChIKeyYZWDXGZNKVQTDG-UHFFFAOYSA-N
MW204.27 g/mol
LogP3.27
Rot. Bonds3

About 4-(cyclopenten-1-yl)-1,2-dimethoxybenzene

4-(cyclopenten-1-yl)-1,2-dimethoxybenzene (PubChem CID 71373642) has the molecular formula C13H16O2 and a molecular weight of 204.27 g/mol. Its IUPAC name is 4-(cyclopenten-1-yl)-1,2-dimethoxybenzene.

Molecular Properties

Compound Name4-(cyclopenten-1-yl)-1,2-dimethoxybenzene
PubChem CID71373642
Molecular FormulaC13H16O2
Molecular Weight204.27 g/mol
Exact Mass204.12
IUPAC Name4-(cyclopenten-1-yl)-1,2-dimethoxybenzene
SMILESCOc1ccc(C2=CCCC2)cc1OC
InChIInChI=1S/C13H16O2/c1-14-12-8-7-11(9-13(12)15-2)10-5-3-4-6-10/h5,7-9H,3-4,6H2,1-2H3
InChIKeyYZWDXGZNKVQTDG-UHFFFAOYSA-N
XLogP3.27
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.27
LogP ≤ 53.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

4-(cyclopenten-1-yl)-1-fluoro-2-methoxybenzene
CID 57475769
7-(cyclohexen-1-yl)-2-(3,4-dimethoxyphenyl)imidazo[1,2-a]pyridine
CID 174194024
1-(cyclopenten-1-yl)-3,5-dimethoxybenzene
CID 13172785
3-(cyclohexen-1-yl)-4-methoxyaniline
CID 141347740
cyclopenten-1-yl-(3,4-dimethoxyphenyl)methanamine
CID 55034080
2-(4-methanidyl-3-methoxyphenyl)-5,6-dihydro-4H-indene;yttrium(3+)
CID 21050960
3-(3-cyclopentyloxy-4-methoxyphenyl)cyclopent-2-en-1-ol
CID 18957483
3-(3,4-dimethoxyphenyl)-1,2-dihydropyrrol-5-one
CID 10466009
1,2-dimethoxy-4-(4-methylphenyl)benzene;ethane
CID 142094347
6-(cyclohexen-1-yl)-1,2,3,4-tetrahydronaphthalene
CID 20500285
3-(cyclohexen-1-yl)-4-methoxybenzaldehyde
CID 166845067
2-(3,4-dimethoxyphenyl)-6-methoxy-1,4-dihydronaphthalene
CID 57256243

Frequently Asked Questions

What is the IUPAC name of 4-(cyclopenten-1-yl)-1,2-dimethoxybenzene?
The IUPAC name of 4-(cyclopenten-1-yl)-1,2-dimethoxybenzene (CID 71373642) is 4-(cyclopenten-1-yl)-1,2-dimethoxybenzene.
What is the SMILES notation for 4-(cyclopenten-1-yl)-1,2-dimethoxybenzene?
The canonical SMILES for 4-(cyclopenten-1-yl)-1,2-dimethoxybenzene is COc1ccc(C2=CCCC2)cc1OC.
What is the InChIKey of 4-(cyclopenten-1-yl)-1,2-dimethoxybenzene?
The InChIKey is YZWDXGZNKVQTDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16O2/c1-14-12-8-7-11(9-13(12)15-2)10-5-3-4-6-10/h5,7-9H,3-4,6H2,1-2H3.
What are the key properties of 4-(cyclopenten-1-yl)-1,2-dimethoxybenzene?
4-(cyclopenten-1-yl)-1,2-dimethoxybenzene has a molecular weight of 204.27 g/mol, XLogP of 3.27, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(cyclopenten-1-yl)-1,2-dimethoxybenzene is sourced from PubChem (CID 71373642), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).